Grundinformationen
- Standard-SMILES
CC[C@H]1OC(=O)[C@H](C)[C@@H](O[C@H]2C[C@@](C)(OC)[C@@H](O)[C@H](C)O2)[C@H](C)[C@@H](O[C@@H]2O[C@H](C)C[C@H]([N+](C)(C)[O-])[C@H]2O)[C@](C)(O)C[C@@H](C)C(=O)[C@H](C)[C@@H](O)[C@]1(C)O- InChIKey
LUIPOVCSQJTWHA-RWJQBGPGSA-N- Summenformel
- C37H67NO14
- Durchschnittliche Molmasse
- 749,9 g/mol
- Monoisotopische Masse
- 749,45615582
Überblick
Erythromycin, anhydro-, N-oxide has been reported in Saccharopolyspora erythraea with data available.
Namen und Bezeichner
- Bevorzugter Name
- Erythromycin, anhydro-, N-oxide
- IUPAC
- (2S,3R,4S,6R)-2-[[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-3-hydroxy-N,N,6-trimethyloxan-4-amine oxide
- Englischer Name
- USAF EL-99
- Summenformel
- C37H65NO13
- Molmasse
- 731.914
Namen und Synonyme
Erythromycin, anhydro-, N-oxide63950-90-3DTXSID50213784(2S,3R,4S,6R)-2-[[(3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-[(2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl]oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl]oxy]-3-hydroxy-N,N,6-trimethyloxan-4-amine oxide(2S,3R,4S,6R)-2-(((3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-((2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyloxan-2-yl)oxy-3,5,7,9,11,13-hexamethyl-2,10-dioxo-oxacyclotetradec-6-yl)oxy)-3-hydroxy-N,N,6-trimethyloxan-4-amine oxideRefChem:1084258DTXCID80136275Erythromycin A N-oxide992-65-4T9KL5GX5WQAnhydroerythromycin-N-oxideErythromycin EP Impurity H
Weitere Namen anzeigen
Erythromycin, N-oxideErythromycin A N-oxide (>80%)(2S,3R,4S,6R)-2-(((3R,4S,5S,6R,7R,9R,11R,12R,13S,14R)-14-ethyl-7,12,13-trihydroxy-4-(((2R,4R,5S,6S)-5-hydroxy-4-methoxy-4,6-dimethyltetrahydro-2H-pyran-2-yl)oxy)-3,5,7,9,11,13-hexamethyl-2,10-dioxooxacyclotetradecan-6-yl)oxy)-3-hydroxy-N,N,6-trimethyltetrahydro-2H-pyran-4-amine oxideUSAF EL-99UNII-T9KL5GX5WQorb1692890SCHEMBL14342543LUIPOVCSQJTWHA-RWJQBGPGSA-N
Datenbank-Bezeichner
- CAS
63950-90-3、992-65-4- PubChem CID
- 88121
- DTXSID
DTXSID50213784- UNII
- T9KL5GX5WQ
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,7
- Polarare Oberfläche (TPSA)
- 209 Ų
- H-Brücken-Donoren
- 5
- H-Brücken-Akzeptoren
- 14
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 52
- Formalladung
- 0
- Komplexität
- 1.220
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